3-[butan-2-yl(methyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[butan-2-yl(methyl)sulfamoyl]benzoic acid Openeye Name: 3-[methyl(sec-butyl)sulfamoyl]benzoic acid CAS Name: 3-[butan-2-yl(methyl)sulfamoyl]benzoic acid IUPAC Name: 3-[butan-2-yl(methyl)sulfamoyl]benzoic acid Traditional Name: 3-[methyl(sec-butyl)sulfamoyl]benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CCC(C)N(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C12H17NO4S/c1-4-9(2)13(3)18(16,17)11-7-5-6-10(8-11)12(14)15/h5-9H,4H2,1-3H3,(H,14,15)